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SMILES: C(=O)(c1c(ccnc1)Br)O Canonical SMILES: OC(=O)c1cnccc1Br InChI: InChI=1S/C6H4BrNO2/c7-5-1-2-8-3-4(5)6(9)10/h1-3H,(H,9,10) InChIKey: CZLOEKRJQIAKFI-UHFFFAOYSA-N
CBID:19128 http://www.chembase.cn/molecule-19128.html